SCHEMBL7914259

SCHEMBL7914259

O=C[Si]CCCCOc1ccc(C(=O)Oc2ccc3c(C(F)(F)F)cc(=O)oc3c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AR P10275 14/20 0.54
AGER Q15109 2/20 0.52
PPARA Q07869 1/20 0.50
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
HPGD P15428 1/20 0.45
MAOB P27338 1/20 0.45
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
NPBWR1 P48145 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7917797 0.86 KDM4E (0.61) ARKDM4EALDH1A1KMT2AMEN1
SCHEMBL7917178 0.82 GBA1 (0.61) KDM4EALDH1A1KMT2AMEN1MAOB
SCHEMBL8835405 0.81 AR (0.54) ARAGERPPARAKDM4EALDH1A1
SCHEMBL7917894 0.81 ALDH1A1 (0.50) KDM4EALDH1A1KMT2AMEN1HPGD
SCHEMBL7907574 0.81 GBA1 (0.60) KDM4EALDH1A1KMT2AMEN1MAOB
SCHEMBL7920873 0.81 GBA1 (0.60) KDM4EALDH1A1KMT2AMEN1MAOB
SCHEMBL7907372 0.80 AR (0.54) ARAGERPPARAKDM4EALDH1A1
SCHEMBL7920875 0.79 GBA1 (0.63) KDM4EALDH1A1KMT2AMEN1MAOB
SCHEMBL28435933 0.78 AR (0.64) ARAGERKDM4EALDH1A1KMT2A
SCHEMBL29724434 0.78 AR (0.64) ARAGERKDM4EALDH1A1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6201087-B1 POLYMERS WHICH CONTAIN COUMARIN OR QUINOLINONE DERIVATIVES AS PHOTOREACTIVE UNITS AS ORIENTING LAYERS FOR LIQUID CRYSTALS; PHOTOCHEMICAL STABILITY AND IMPROVED CONTRAST ROLIC AG (CH) 2001-03-13 US disclosed
EP-0783537-B1 CUMARIN AND QUINOLINONE DERIVATIVES FOR PREPARING LIQUID CRYSTAL ORIENTATION LAYERS ROLIC AG (CH) 1999-12-01 EP disclosed
EP-0783537-A1 CUMARIN AND QUINOLINONE DERIVATIVES FOR PREPARING LIQUID CRYSTAL ORIENTATION LAYERS F. HOFFMANN-LA ROCHE AG (CH) 1997-07-16 EP disclosed
WO-1996010049-A1 CUMARIN AND QUINOLINONE DERIVATIVES FOR PREPARING LIQUID CRYSTAL ORIENTATION LAYERS F. HOFFMANN-LA ROCHE AG (CH) 1996-04-04 WO disclosed